Bioactive Compound Details
| BioID | bio199893 |
|---|---|
| Name | 2-OXOALANTOLACTONE |
| ChEMBL ID | CHEMBL2380793 |
| Molecular Formula | C15H18O3 |
| Molecular Weight | 246.31 |
| Molecular Weight (Monoisotopic) | 246.1256 |
| Type | Small molecule |
| Max Phase | -- |
| Target ID | Tar81 |
| Target Name | None |
| Synonyms | None |
| Smiles | C=C1C(=O)O[C@@H]2C[C@@]3(C)CC(=O)C[C@H](C)C3=C[C@H]12 |
| Inchi | InChI=1S/C15H18O3/c1-8-4-10(16)6-15(3)7-13-11(5-12(8)15)9(2)14(17)18-13/h5,8,11,13H,2,4,6-7H2,1,3H3/t8-,11+,13+,15+/m0/s1 |
| Inchi Key | DSTJGYCTYZXZNH-DGFVYPATSA-N |
| Molecular Species | NEUTRAL |
| Targets | 2.0 |
| Bioactivities | 3.0 |
| Np Likeness Score | 2.9 |
| Records Key | ['32'] |
| Records Name | ['2-Oxoalantolactone'] |
| Withdrawn Flag | False |
| Orphan | -1 |
Molecular Structure
